| CAS Number: 90110-97-7 2-bromo-4-(hydroxymethyl)benzonitrile |
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| General Information | ||||||
| Product Number: 90110977
CAS Registry Number: 90110-97-7
Name:
Benzonitrile, 2-bromo-4-(hydroxymethyl)-
p-Tolunitrile, 2-bromo-α-hydroxy- (7CI); 2-Bromo-4-(hydroxymethyl)benzonitrile; NSC 149635
Chemical Formula: C8H6BrNO
Exact Mass: 210.96
Molecular Weight: 212.04
m/z: 210.96 (100.0%), 212.96 (97.3%), 213.96 (8.8%), 211.97 (8.8%)
Elemental Analysis: C, 45.31; H, 2.85; Br, 37.68; N, 6.61; O, 7.55
InChI: InChI=1S/C8H6BrNO/c9-8-3-6(5-11)1-2-7(8)4-10/h1-3,11H,5H2
InChIKey: APZLAHOHUDEQQM-UHFFFAOYSA-N
Canonical SMILES : C1=CC(=C(C=C1CO)Br)C#N
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Specification |
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98% |
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| References | ||||||
PCT Int. Appl. (2014), WO 2014055916 A1 20140410. PCT Int. Appl. (2001), WO 2001081316 A2 20011101. |
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